2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane

C13H24OSi — CID 12705566

IUPAC2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane
SMILESC[Si](C)(C)OC1=C2CCCCC2CCC1
InChIInChI=1S/C13H24OSi/c1-15(2,3)14-13-10-6-8-11-7-4-5-9-12(11)13/h11H,4-10H2,1-3H3
InChIKeyBJEHRBSAQYFWHU-UHFFFAOYSA-N
MW224.42 g/mol
LogP4.47
Rot. Bonds2

About 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane

2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane (PubChem CID 12705566) has the molecular formula C13H24OSi and a molecular weight of 224.42 g/mol. Its IUPAC name is 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane.

Molecular Properties

Compound Name2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane
PubChem CID12705566
Molecular FormulaC13H24OSi
Molecular Weight224.42 g/mol
Exact Mass224.16
IUPAC Name2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane
SMILESC[Si](C)(C)OC1=C2CCCCC2CCC1
InChIInChI=1S/C13H24OSi/c1-15(2,3)14-13-10-6-8-11-7-4-5-9-12(11)13/h11H,4-10H2,1-3H3
InChIKeyBJEHRBSAQYFWHU-UHFFFAOYSA-N
XLogP4.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane?
The IUPAC name of 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane (CID 12705566) is 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane.
What is the SMILES notation for 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane?
The canonical SMILES for 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane is C[Si](C)(C)OC1=C2CCCCC2CCC1.
What is the InChIKey of 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane?
The InChIKey is BJEHRBSAQYFWHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24OSi/c1-15(2,3)14-13-10-6-8-11-7-4-5-9-12(11)13/h11H,4-10H2,1-3H3.
What are the key properties of 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane?
2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane has a molecular weight of 224.42 g/mol, XLogP of 4.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,4a,5,6,7,8-octahydronaphthalen-1-yloxy(trimethyl)silane is sourced from PubChem (CID 12705566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).